Geometry & MOs

Info

ID:	298907
PubChem CID:	117664156
Reduced:	F2C15H20 (1)
Stoich.:	A2B15C20 (1)
Weight, g/mol:	405.135638
ΔH_f, kcal/mol:	-103.03
Dipole, Da:	3.59
IP(EA), eV:	-9.44(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(5-chloropyridin-3-yl)-3-(6-piperidin-3-yloxypyrazin-2-yl)-1H-indole

Drug info:

PubChemData

Smile

CC(C)(C1CCCCC1)C2=CC(=C(C=C2)F)F

DOS

IR

Vibrations